Geometry & MOs

Info

ID:	17881
PubChem CID:	525049
Reduced:	ClNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-70.64
Dipole, Da:	5.2
IP(EA), eV:	-8.79(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)heptanamide

Drug info:

PubChemData

Smile

CCCCCCC(=O)NC1=CC(=C(C=C1)C)Cl

DOS

IR

Vibrations